Acetic Acid

Acetic Acid

SCHEMBL1970150

CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CCC(N)(O)CN.[Na+].[Na+].[Na+]

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Acetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.41
FFAR3 O14843 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
CA4 P22748 2/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Acetic Acid SCHEMBL5083116 0.95 CA1 (0.36) CA1CA4
Acetic Acid SCHEMBL5082566 0.95 CA1 (0.36) CA1
Acetic Acid SCHEMBL168535 0.86 MEN1 (0.35) FFAR3
Acetic Acid SCHEMBL5446128 0.86 MEN1 (0.35) FFAR3
Acetic Acid SCHEMBL1970151 0.84 MEN1 (0.34) FFAR3
SCHEMBL321976 0.83
Carbamic Acid SCHEMBL19211626 0.81 MEN1 (0.35) FFAR3
SCHEMBL20678765 0.80
Trimethylammonium SCHEMBL27297434 0.75
Acetic Acid SCHEMBL11415707 0.75 CA1 (0.44) CA1FFAR3HDAC3HDAC1HDAC2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1009780-B1 DEICING AND ANTI-ICING COMPOSITION FOR AIRCRAFT OCTAGON PROCESS INC (US) 2001-07-18 EP claimed
EP-1009780-A4 DEICING AND ANTI-ICING COMPOSITION FOR AIRCRAFT OCTAGON PROCESS INC (US) 2000-07-26 EP claimed
EP-1009780-A1 DEICING AND ANTI-ICING COMPOSITION FOR AIRCRAFT OCTAGON PROCESS INC. (US) 2000-06-21 EP claimed
WO-1998046695-A1 DEICING AND ANTI-ICING COMPOSITION FOR AIRCRAFT OCTAGON PROCESS INC. (US) 1998-10-22 WO claimed
US-5817252-A ETHYLENE GLYCOL AND/OR PROPYLENE GLYCOL, TWO NONIONIC SURFACTANTS WITH DIFFERENT HLBS, POLYCARBOXYLATE EMULSIFIER, PH CONTROL OCTAGON PROCESS INC. (US) 1998-10-06 US claimed
EP-3750956-A1 POWDER-CONTAINING COMPOSITION, POWDER FOR AQUEOUS SOLVENT, AND PRODUCTION METHOD OF POWDER FOR AQUEOUS SOLVENT Shiseido Company, Ltd. (JP) 2020-12-16 EP disclosed
WO-2013191695-A1 VISCOELASTIC SURFACTANTS IN MIXED BRINES M-I L.L.C. (US) 2013-12-27 WO disclosed
EP-2542631-A1 INKJET RECORDING INK SET, INKJET RECORDING METHOD AND RECORDED MATTER Ricoh Company, Limited (JP) 2013-01-09 EP disclosed
WO-2011108756-A9 INKJET RECORDING INK SET, INKJET RECORDING METHOD AND RECORDED MATTER RICOH COMPANY, LTD. (JP) 2012-09-27 WO disclosed
US-8178597-B2 Aqueous inkjet recording ink and method for producing the same FUJIFILM CORPORATION (JP) 2012-05-15 US disclosed
WO-2011108756-A1 INKJET RECORDING INK SET, INKJET RECORDING METHOD AND RECORDED MATTER RICOH COMPANY, LTD. (JP) 2011-09-09 WO disclosed
EP-2090626-B1 Aqueous inkjet recording ink and method for producing the same FUJIFILM CORP (JP) 2011-06-22 EP disclosed
WO-2009113896-A1 SLIP-LAYER FLUID PLACEMENT SCHLUMBERGER CANADA LIMITED (CA) 2009-09-17 WO disclosed
US-20090234058-A1 AQUEOUS INK COMPOSITION FUJIFILM CORPORATION (JP) 2009-09-17 US disclosed
EP-2090626-A1 Aqueous inkjet recording ink and method for producing the same FUJIFILM Corporation (JP) 2009-08-19 EP disclosed
US-20090203823-A1 AQUEOUS INKJET RECORDING INK AND METHOD FOR PRODUCING THE SAME FUJIFILM CORPORATION (JP) 2009-08-13 US disclosed
WO-2008139337-A1 DETERGENT COMPONENT FOR PREVENTING PRECIPITATION OF WATER HARDNESS AND PROVIDING SOIL REMOVAL PROPERTIES ECOLAB INC. (US) 2008-11-20 WO disclosed
EP-1455851-A1 NATURAL FIBERS TREATED WITH ACIDIC ODOR CONTROL/BINDER SYSTEMS Kimberly-Clark Worldwide, Inc. (US) 2004-09-15 EP disclosed
WO-2003051413-A1 NATURAL FIBERS TREATED WITH ACIDIC ODOR CONTROL/BINDER SYSTEMS KIMBERLY-CLARK WORLDWIDE, INC. (US) 2003-06-26 WO disclosed
EP-0214868-A2 Surfactants for use in cleaning compositions BEROL NOBEL AB (SE) 1987-03-18 EP disclosed